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TitleSelective Class I HDAC Inhibitors Based on Aryl Ketone Zinc Binding Induce HIV-1 Protein for Clearance.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 11, Page 1476-1483, Year 2020
Publish dateJun 11, 2020 (structure data deposition date)
AuthorsLiu, J. / Kelly, J. / Yu, W. / Clausen, D. / Yu, Y. / Kim, H. / Duffy, J.L. / Chung, C.C. / Myers, R.W. / Carroll, S. ...Liu, J. / Kelly, J. / Yu, W. / Clausen, D. / Yu, Y. / Kim, H. / Duffy, J.L. / Chung, C.C. / Myers, R.W. / Carroll, S. / Klein, D.J. / Fells, J. / Holloway, M.K. / Wu, J. / Wu, G. / Howell, B.J. / Barnard, R.J.O. / Kozlowski, J.A.
External linksAcs Med. Chem. Lett. / PubMed:32676157
MethodsX-ray diffraction
Resolution1.56 Å
Structure data

PDB-6xdm:
STRUCTURE OF HUMAN HDAC2 IN COMPLEX WITH AN ARYL KETONE INHIBITOR
Method: X-RAY DIFFRACTION / Resolution: 1.56 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-CA:
Unknown entry

ChemComp-SO4:
SULFATE ION

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-V1D:
N-[(1S)-1-[4-(2-fluorophenyl)-1H-imidazol-2-yl]-7,7-dihydroxy-7-(1,2-oxazol-3-yl)heptyl]-1-methylazetidine-3-carboxamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / HISTONE DEACETYLASE / HYDROLASE / HYDROLASE-HYDROLASE INHIBITOR COMPLEX

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